[4-[(2,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-phenyl-methanone

Systemtic Name: [4-[(2,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-phenyl-methanone Openeye Name: [4-[(2,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-phenyl-methanone CAS Name: [4-[(2,4-dimethoxyphenyl)methyl]-1-piperazin-4-iumyl]-phenylmethanone IUPAC Name: [4-[(2,4-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]-phenylmethanone Traditional Name: [4-(2,4-dimethoxybenzyl)piperazin-4-ium-1-yl]-phenyl-methanone Formula: C20H25N2O3+ MolecularWeight: 341.4241

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C20H24N2O3/c1-24-18-9-8-17(19(14-18)25-2)15-21-10-12-22(13-11-21)20(23)16-6-4-3-5-7-16/h3-9,14H,10-13,15H2,1-2H3/p+1